Geometry & MOs

Info

ID:	266965
PubChem CID:	103580239
Reduced:	BrClON3C15H15 (1)
Stoich.:	ABCD3E15F15 (1)
Weight, g/mol:	318.01345
ΔH_f, kcal/mol:	1.14
Dipole, Da:	5.88
IP(EA), eV:	-8.72(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(5-bromo-3-chloropyridin-2-yl)piperidin-4-yl]ethanol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NCCNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations